==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE(O-GLYCOSYL) 27-SEP-93 224L . COMPND 2 MOLECULE: T4 LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR M.BLABER,B.W.MATTHEWS . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8584.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 116 71.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 7.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 7 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 85 52.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 1 0 1 2 1 0 0 1 1 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A M 0 0 73 0, 0.0 2,-0.3 0, 0.0 157,-0.0 0.000 360.0 360.0 360.0 145.2 43.6 -1.7 9.0 2 2 A N > - 0 0 70 156,-0.0 4,-2.0 95,-0.0 3,-0.2 -0.898 360.0 -85.0-147.7 175.0 40.4 -0.8 10.8 3 3 A I H > S+ 0 0 28 -2,-0.3 4,-2.6 1,-0.2 5,-0.3 0.869 124.1 52.5 -55.1 -44.3 38.3 2.3 11.3 4 4 A F H > S+ 0 0 79 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.912 112.4 42.7 -61.5 -45.7 40.4 3.6 14.2 5 5 A E H > S+ 0 0 98 -3,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.812 112.5 55.7 -69.6 -32.5 43.7 3.4 12.3 6 6 A M H X S+ 0 0 0 -4,-2.0 4,-1.8 1,-0.2 -2,-0.2 0.934 111.4 41.2 -65.6 -49.3 42.1 4.8 9.2 7 7 A L H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 5,-0.4 0.799 108.2 61.3 -69.6 -30.2 40.9 7.9 10.9 8 8 A R H X S+ 0 0 101 -4,-1.6 4,-1.6 -5,-0.3 -1,-0.2 0.896 106.8 46.9 -66.4 -31.5 44.1 8.3 12.8 9 9 A I H < S+ 0 0 88 -4,-1.4 -2,-0.2 1,-0.2 -1,-0.2 0.921 116.0 44.2 -73.6 -42.1 45.8 8.6 9.5 10 10 A D H < S+ 0 0 20 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.809 124.5 30.3 -73.1 -31.3 43.3 11.1 8.1 11 11 A E H < S- 0 0 42 -4,-2.3 19,-0.4 -5,-0.1 -3,-0.2 0.667 90.9-152.8-100.5 -27.3 43.0 13.4 11.2 12 12 A G < - 0 0 22 -4,-1.6 2,-0.4 -5,-0.4 -1,-0.1 -0.145 24.5 -87.2 74.6-175.2 46.4 13.2 12.8 13 13 A L + 0 0 40 16,-0.1 2,-0.4 -4,-0.1 16,-0.2 -0.988 42.5 172.5-133.6 126.9 46.9 13.7 16.6 14 14 A R E -A 28 0A 141 14,-1.4 14,-1.9 -2,-0.4 4,-0.1 -0.999 20.0-160.9-136.9 129.8 47.5 17.1 18.2 15 15 A L E S+ 0 0 66 -2,-0.4 43,-1.8 12,-0.2 2,-0.3 0.344 74.8 62.4 -90.6 5.0 47.6 17.6 21.9 16 16 A K E S-C 57 0B 94 41,-0.2 41,-0.2 12,-0.1 12,-0.1 -0.941 99.9 -87.0-131.4 147.8 47.0 21.4 21.8 17 17 A I E + 0 0 17 39,-1.4 2,-0.3 -2,-0.3 10,-0.2 -0.260 58.9 167.8 -51.2 134.5 44.0 23.3 20.5 18 18 A Y E -A 26 0A 28 8,-2.8 8,-3.2 -4,-0.1 2,-0.4 -0.866 36.4-101.8-140.9 178.3 44.5 23.9 16.8 19 19 A K E -A 25 0A 126 -2,-0.3 6,-0.2 6,-0.2 5,-0.1 -0.888 33.5-137.6-108.3 132.5 42.4 25.1 13.9 20 20 A D > - 0 0 51 4,-3.1 3,-1.5 -2,-0.4 -1,-0.1 -0.038 40.7 -80.8 -74.7-173.1 41.1 22.6 11.4 21 21 A T T 3 S+ 0 0 109 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.741 132.3 46.4 -59.5 -28.8 41.0 22.9 7.7 22 22 A E T 3 S- 0 0 77 2,-0.1 -1,-0.3 0, 0.0 -2,-0.0 0.362 125.0 -99.9 -97.2 -0.0 37.8 25.1 7.8 23 23 A G S < S+ 0 0 36 -3,-1.5 2,-0.3 1,-0.3 -2,-0.1 0.525 75.4 143.5 93.3 7.3 39.3 27.3 10.5 24 24 A Y - 0 0 78 1,-0.1 -4,-3.1 -5,-0.1 2,-0.3 -0.600 58.5-102.4 -91.4 147.2 37.5 25.6 13.5 25 25 A Y E +AB 19 34A 35 9,-0.7 8,-3.1 11,-0.4 9,-1.3 -0.429 54.4 163.0 -63.5 117.9 38.8 25.1 16.9 26 26 A T E -AB 18 32A 2 -8,-3.2 -8,-2.8 -2,-0.3 2,-0.3 -0.834 18.5-171.8-133.8 167.9 39.8 21.4 17.2 27 27 A I E > + B 0 31A 0 4,-1.3 4,-1.8 -2,-0.3 -12,-0.2 -0.984 52.2 1.4-155.8 162.5 41.9 19.1 19.5 28 28 A G E 4 S-A 14 0A 0 -14,-1.9 -14,-1.4 -2,-0.3 2,-0.9 -0.357 122.9 -5.6 64.2-132.4 43.1 15.5 19.6 29 29 A I T 4 S- 0 0 3 34,-0.5 -1,-0.2 -16,-0.2 -17,-0.1 -0.647 127.3 -52.3 -99.7 73.9 42.1 13.2 16.7 30 30 A G T 4 S+ 0 0 16 -2,-0.9 2,-1.0 -19,-0.4 -2,-0.2 0.786 84.6 159.9 68.7 24.9 39.8 15.5 14.7 31 31 A H E < -B 27 0A 34 -4,-1.8 -4,-1.3 1,-0.0 -1,-0.2 -0.695 34.0-142.8 -83.9 100.5 37.6 16.3 17.7 32 32 A L E -B 26 0A 68 -2,-1.0 -6,-0.2 -6,-0.2 3,-0.1 -0.303 19.6-176.7 -60.1 133.0 35.7 19.6 16.7 33 33 A L E - 0 0 15 -8,-3.1 2,-0.3 1,-0.4 -7,-0.2 0.900 56.6 -23.1 -98.7 -51.2 35.4 21.8 19.7 34 34 A T E -B 25 0A 30 -9,-1.3 -9,-0.7 2,-0.1 -1,-0.4 -0.974 37.8-140.9-156.8 153.2 33.3 24.8 18.6 35 35 A K S S+ 0 0 134 -2,-0.3 -1,-0.1 -11,-0.1 7,-0.0 0.548 73.3 108.2 -93.8 -8.7 32.5 26.7 15.5 36 36 A S S S- 0 0 42 1,-0.1 -11,-0.4 2,-0.1 -2,-0.1 -0.257 76.9-125.7 -67.1 152.6 32.8 30.0 17.2 37 37 A P S S+ 0 0 122 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.515 78.9 106.6 -75.9 -2.2 35.7 32.4 16.7 38 38 A S > - 0 0 51 1,-0.2 4,-1.6 2,-0.1 -2,-0.1 -0.681 52.5-166.7 -92.5 124.4 36.5 32.4 20.3 39 39 A L H > S+ 0 0 69 -2,-0.6 4,-2.1 1,-0.2 -1,-0.2 0.780 96.4 53.1 -70.6 -26.8 39.4 30.6 21.7 40 40 A N H > S+ 0 0 123 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.893 104.7 52.2 -76.5 -37.8 38.0 31.1 25.1 41 41 A A H > S+ 0 0 31 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.894 111.1 51.0 -60.8 -34.3 34.8 29.6 24.0 42 42 A A H X S+ 0 0 0 -4,-1.6 4,-2.6 2,-0.2 -2,-0.2 0.875 107.5 50.6 -70.1 -39.6 37.0 26.7 22.8 43 43 A K H X S+ 0 0 49 -4,-2.1 4,-2.4 2,-0.2 11,-0.3 0.884 109.9 53.2 -64.3 -37.9 38.8 26.3 26.1 44 44 A S H X S+ 0 0 71 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.949 110.2 43.6 -63.8 -52.5 35.5 26.2 27.7 45 45 A E H X S+ 0 0 64 -4,-2.0 4,-2.3 1,-0.2 5,-0.2 0.940 112.2 56.9 -59.4 -43.7 34.1 23.4 25.6 46 46 A L H X S+ 0 0 0 -4,-2.6 4,-1.9 1,-0.2 5,-0.2 0.937 106.8 45.4 -55.0 -47.8 37.4 21.6 26.0 47 47 A D H X>S+ 0 0 35 -4,-2.4 4,-2.5 1,-0.2 5,-1.1 0.847 112.9 51.9 -65.0 -33.6 37.3 21.6 29.8 48 48 A K H <5S+ 0 0 145 -4,-1.7 -1,-0.2 2,-0.2 -2,-0.2 0.855 109.2 50.3 -67.4 -38.7 33.7 20.5 29.8 49 49 A A H <5S+ 0 0 42 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.859 120.6 34.6 -70.4 -31.9 34.6 17.6 27.4 50 50 A I H <5S- 0 0 37 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.738 101.4-124.9 -96.2 -31.2 37.4 16.4 29.6 51 51 A G T <5S+ 0 0 68 -4,-2.5 2,-0.3 1,-0.3 -3,-0.2 0.744 78.2 70.6 90.2 24.2 36.1 17.1 33.0 52 52 A R S - 0 0 7 -2,-1.0 3,-1.6 -11,-0.3 -1,-0.2 0.690 32.1-145.2 -96.2 -15.5 42.9 21.9 30.9 55 55 A N T 3 S- 0 0 116 1,-0.2 -2,-0.1 -12,-0.1 3,-0.1 0.884 74.8 -59.0 52.3 39.9 44.2 25.3 29.8 56 56 A G T 3 S+ 0 0 0 -13,-0.2 -39,-1.4 1,-0.1 2,-0.4 0.418 116.6 102.9 71.3 4.3 44.0 24.0 26.1 57 57 A V B < +C 16 0B 73 -3,-1.6 2,-0.3 -41,-0.2 -41,-0.2 -0.963 43.2 174.2-123.9 135.6 46.3 21.1 26.6 58 58 A I - 0 0 4 -43,-1.8 2,-0.2 -2,-0.4 -30,-0.1 -0.848 26.4-112.7-131.4 165.0 45.4 17.4 26.9 59 59 A T > - 0 0 66 -2,-0.3 4,-2.4 1,-0.1 3,-0.4 -0.562 33.2-102.7 -95.4 168.2 47.2 14.1 27.2 60 60 A K H > S+ 0 0 98 1,-0.3 4,-2.0 2,-0.2 5,-0.2 0.853 121.0 51.7 -54.1 -46.3 47.4 11.2 24.8 61 61 A D H > S+ 0 0 119 2,-0.2 4,-2.3 1,-0.2 -1,-0.3 0.874 109.4 49.9 -61.7 -41.1 45.0 9.1 26.8 62 62 A E H > S+ 0 0 39 -3,-0.4 4,-2.3 2,-0.2 -2,-0.2 0.919 110.0 51.0 -65.7 -41.7 42.4 12.0 26.9 63 63 A A H X S+ 0 0 0 -4,-2.4 4,-1.8 1,-0.2 -34,-0.5 0.861 111.9 47.8 -57.4 -42.0 42.7 12.4 23.1 64 64 A E H X S+ 0 0 80 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.857 108.3 53.8 -71.7 -37.2 42.1 8.7 22.7 65 65 A K H X S+ 0 0 137 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.942 110.5 46.4 -62.6 -46.8 39.2 8.7 25.0 66 66 A L H X S+ 0 0 4 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.892 111.9 53.0 -58.2 -42.3 37.5 11.6 23.0 67 67 A F H X S+ 0 0 11 -4,-1.8 4,-2.1 2,-0.2 5,-0.3 0.945 107.1 49.8 -60.8 -51.4 38.3 9.7 19.7 68 68 A N H X S+ 0 0 86 -4,-2.5 4,-2.3 1,-0.2 5,-0.2 0.916 112.0 49.4 -57.9 -38.8 36.7 6.4 20.9 69 69 A Q H X S+ 0 0 88 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.895 111.2 49.2 -65.3 -42.1 33.5 8.4 21.9 70 70 A D H X S+ 0 0 34 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.784 110.5 48.5 -68.8 -31.7 33.4 10.1 18.6 71 71 A V H X S+ 0 0 5 -4,-2.1 4,-2.7 2,-0.2 5,-0.2 0.932 112.8 49.7 -72.3 -43.6 33.7 6.9 16.6 72 72 A D H X S+ 0 0 85 -4,-2.3 4,-2.2 -5,-0.3 5,-0.2 0.940 112.6 47.2 -56.6 -45.8 31.0 5.3 18.8 73 73 A A H X S+ 0 0 43 -4,-2.3 4,-2.8 -5,-0.2 -1,-0.2 0.900 109.6 53.8 -65.3 -41.0 28.7 8.3 18.2 74 74 A A H X S+ 0 0 10 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.978 110.4 45.7 -58.0 -56.4 29.4 8.3 14.4 75 75 A V H X S+ 0 0 35 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.926 115.4 47.6 -49.7 -51.5 28.4 4.6 14.1 76 76 A R H X S+ 0 0 112 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.875 108.5 53.6 -63.6 -37.2 25.2 5.2 16.3 77 77 A G H X S+ 0 0 4 -4,-2.8 4,-0.6 -5,-0.2 -1,-0.2 0.927 110.1 48.6 -64.9 -38.2 24.2 8.2 14.4 78 78 A I H >< S+ 0 0 0 -4,-2.0 3,-1.0 -5,-0.2 7,-0.3 0.932 111.3 50.0 -62.6 -46.4 24.4 6.2 11.1 79 79 A L H 3< S+ 0 0 69 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.813 113.1 46.4 -66.3 -27.2 22.4 3.4 12.7 80 80 A R H 3< S+ 0 0 177 -4,-2.1 2,-0.4 -5,-0.2 -1,-0.3 0.491 92.6 94.9 -89.0 -10.9 19.7 5.8 13.8 81 81 A N S+ 0 0 122 2,-0.1 4,-0.5 1,-0.1 -1,-0.2 0.737 119.3 40.8 -84.7 -31.9 18.8 7.5 5.1 84 84 A L H > S+ 0 0 0 -7,-0.2 4,-2.5 -6,-0.2 5,-0.3 0.847 99.8 68.6 -88.5 -36.6 22.1 6.1 6.3 85 85 A K H X S+ 0 0 87 -4,-2.4 4,-2.4 -7,-0.3 5,-0.2 0.909 99.0 49.4 -51.4 -47.2 21.1 2.9 7.9 86 86 A P H > S+ 0 0 54 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.891 111.8 49.8 -63.7 -36.3 20.1 1.1 4.7 87 87 A V H >X S+ 0 0 3 -4,-0.5 4,-0.8 -3,-0.2 3,-0.6 0.978 111.2 47.4 -65.6 -52.7 23.3 2.0 3.0 88 88 A Y H >< S+ 0 0 33 -4,-2.5 3,-1.7 1,-0.2 -1,-0.2 0.939 110.3 53.1 -51.7 -51.1 25.5 0.9 5.8 89 89 A D H 3< S+ 0 0 78 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.833 107.4 52.5 -57.9 -31.7 23.6 -2.5 6.1 90 90 A S H << S+ 0 0 38 -4,-1.4 -1,-0.3 -3,-0.6 -2,-0.2 0.629 96.9 89.7 -79.3 -14.6 24.1 -3.2 2.5 91 91 A L S << S- 0 0 6 -3,-1.7 31,-0.0 -4,-0.8 30,-0.0 -0.555 74.4-118.5 -91.7 157.1 27.8 -2.6 2.5 92 92 A D > - 0 0 55 -2,-0.2 4,-1.9 1,-0.1 5,-0.2 -0.171 45.2 -93.7 -73.3 173.3 30.8 -5.0 3.1 93 93 A S H > S+ 0 0 99 2,-0.2 4,-1.3 1,-0.2 -1,-0.1 0.807 121.8 50.9 -63.1 -35.0 33.1 -4.2 6.1 94 94 A V H > S+ 0 0 19 2,-0.2 4,-1.3 62,-0.2 3,-0.4 0.974 112.9 45.2 -67.1 -51.6 35.7 -2.1 4.3 95 95 A R H > S+ 0 0 23 1,-0.3 4,-1.7 2,-0.2 5,-0.2 0.844 106.5 59.8 -62.2 -34.7 33.1 0.2 2.7 96 96 A R H X S+ 0 0 81 -4,-1.9 4,-2.4 1,-0.2 -1,-0.3 0.906 103.0 53.2 -60.7 -38.9 31.3 0.5 6.0 97 97 A A H X S+ 0 0 7 -4,-1.3 4,-2.2 -3,-0.4 -1,-0.2 0.904 106.2 53.6 -60.4 -40.1 34.5 2.0 7.3 98 98 A A H X S+ 0 0 0 -4,-1.3 4,-1.7 2,-0.2 -1,-0.2 0.816 109.1 47.5 -63.3 -35.9 34.5 4.5 4.4 99 99 A L H X S+ 0 0 1 -4,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.886 110.1 53.0 -74.9 -36.4 31.0 5.7 5.3 100 100 A I H X S+ 0 0 7 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.919 106.9 52.9 -61.8 -40.7 31.9 6.0 8.9 101 101 A N H X S+ 0 0 0 -4,-2.2 4,-1.6 1,-0.2 -1,-0.2 0.951 108.6 48.9 -62.5 -46.3 34.9 8.2 8.0 102 102 A M H X S+ 0 0 3 -4,-1.7 4,-3.2 1,-0.2 5,-0.4 0.927 112.0 49.6 -57.2 -45.6 32.7 10.6 6.0 103 103 A V H X S+ 0 0 8 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.930 108.9 51.9 -62.2 -41.3 30.2 10.8 8.9 104 104 A F H < S+ 0 0 30 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.839 117.0 39.6 -61.5 -35.5 33.0 11.5 11.4 105 105 A Q H < S+ 0 0 57 -4,-1.6 -2,-0.2 -3,-0.2 -1,-0.2 0.841 132.4 19.9 -83.5 -42.8 34.3 14.4 9.1 106 106 A M H X S- 0 0 52 -4,-3.2 4,-0.6 -5,-0.2 -3,-0.2 0.429 102.9-118.7-115.9 2.2 31.1 15.9 7.9 107 107 A G H X - 0 0 34 -4,-2.2 4,-2.4 -5,-0.4 5,-0.2 0.235 34.2 -76.4 74.9 158.6 28.4 14.9 10.3 108 108 A E H > S+ 0 0 52 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.872 127.4 50.1 -56.2 -48.4 25.3 12.8 9.7 109 109 A T H > S+ 0 0 119 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.945 109.3 51.8 -61.6 -46.7 23.2 15.5 8.1 110 110 A G H >< S+ 0 0 32 -4,-0.6 3,-1.0 1,-0.2 -2,-0.2 0.956 114.0 42.4 -53.6 -56.8 26.0 16.4 5.7 111 111 A V H >< S+ 0 0 0 -4,-2.4 3,-2.9 1,-0.3 -2,-0.2 0.912 105.9 61.8 -58.5 -46.1 26.4 12.8 4.5 112 112 A A H 3< S+ 0 0 14 -4,-3.0 -1,-0.3 1,-0.3 -2,-0.2 0.767 96.3 66.7 -50.5 -26.0 22.6 12.2 4.4 113 113 A G T << S+ 0 0 55 -4,-1.2 2,-1.3 -3,-1.0 -1,-0.3 0.516 73.4 85.6 -74.5 -10.3 22.7 14.9 1.8 114 114 A F <> + 0 0 42 -3,-2.9 4,-2.6 1,-0.2 3,-0.4 -0.335 56.9 160.2 -88.0 54.2 24.7 12.9 -0.8 115 115 A T H > + 0 0 84 -2,-1.3 4,-1.8 1,-0.2 -1,-0.2 0.825 65.9 43.3 -39.9 -58.5 21.5 11.4 -2.1 116 116 A N H > S+ 0 0 85 -3,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.849 114.6 48.3 -61.8 -42.5 22.6 10.3 -5.5 117 117 A S H > S+ 0 0 1 -3,-0.4 4,-2.5 2,-0.2 5,-0.2 0.890 110.4 53.5 -66.2 -43.8 25.9 8.8 -4.3 118 118 A L H X S+ 0 0 12 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.914 108.3 48.6 -58.6 -44.8 24.2 6.9 -1.5 119 119 A R H X S+ 0 0 116 -4,-1.8 4,-2.0 -5,-0.3 -1,-0.2 0.928 111.9 50.7 -64.4 -37.9 21.7 5.4 -3.9 120 120 A M H <>S+ 0 0 22 -4,-1.8 5,-2.4 2,-0.2 4,-0.3 0.890 108.9 49.8 -66.7 -38.2 24.5 4.4 -6.1 121 121 A L H ><5S+ 0 0 2 -4,-2.5 3,-2.7 1,-0.2 -1,-0.2 0.968 108.0 54.4 -65.4 -45.2 26.5 2.8 -3.4 122 122 A Q H 3<5S+ 0 0 86 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.905 108.6 48.9 -54.1 -39.1 23.4 0.9 -2.3 123 123 A Q T 3<5S- 0 0 82 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.465 113.0-122.1 -80.5 0.5 23.2 -0.4 -5.8 124 124 A K T < 5 + 0 0 99 -3,-2.7 2,-1.2 -4,-0.3 -3,-0.2 0.815 60.2 149.4 59.9 37.4 26.8 -1.4 -5.7 125 125 A R >< + 0 0 122 -5,-2.4 4,-2.3 1,-0.2 -1,-0.2 -0.727 20.5 174.8 -99.3 80.9 27.6 0.8 -8.8 126 126 A W H > + 0 0 52 -2,-1.2 4,-2.0 2,-0.2 -1,-0.2 0.894 69.1 44.0 -57.6 -56.3 31.2 1.5 -7.6 127 127 A D H > S+ 0 0 113 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.937 115.9 50.5 -60.7 -42.1 32.7 3.4 -10.4 128 128 A E H > S+ 0 0 111 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.902 109.0 49.5 -65.2 -38.9 29.6 5.5 -10.8 129 129 A A H X S+ 0 0 1 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.877 109.3 53.3 -65.3 -35.8 29.4 6.4 -7.1 130 130 A A H X S+ 0 0 11 -4,-2.0 4,-1.0 2,-0.2 -2,-0.2 0.870 108.5 49.9 -67.2 -38.3 33.1 7.4 -7.2 131 131 A V H < S+ 0 0 92 -4,-2.0 4,-0.4 1,-0.2 -1,-0.2 0.915 114.9 43.5 -67.0 -41.6 32.5 9.7 -10.1 132 132 A N H >< S+ 0 0 42 -4,-2.1 3,-1.0 1,-0.2 -2,-0.2 0.834 107.2 57.7 -72.2 -36.6 29.5 11.4 -8.3 133 133 A L H 3< S+ 0 0 2 -4,-2.4 6,-0.4 1,-0.2 -1,-0.2 0.864 99.6 62.4 -62.4 -29.4 31.1 11.7 -4.9 134 134 A A T 3< S+ 0 0 28 -4,-1.0 2,-1.6 1,-0.2 -1,-0.2 0.708 84.8 78.1 -69.8 -20.4 33.9 13.7 -6.5 135 135 A K S < S+ 0 0 156 -3,-1.0 2,-0.3 -4,-0.4 -1,-0.2 -0.574 79.8 96.7 -88.9 71.3 31.5 16.4 -7.6 136 136 A S S > S- 0 0 19 -2,-1.6 4,-1.9 1,-0.1 3,-0.2 -0.995 84.2-116.0-153.4 157.4 31.3 18.0 -4.2 137 137 A R H > S+ 0 0 144 -2,-0.3 4,-3.2 1,-0.2 5,-0.3 0.908 115.2 64.5 -61.3 -37.7 32.8 20.9 -2.1 138 138 A W H > S+ 0 0 19 1,-0.2 4,-2.2 2,-0.2 8,-0.2 0.925 104.4 41.4 -48.8 -51.3 34.1 18.1 0.1 139 139 A Y H 4 S+ 0 0 56 -6,-0.4 -1,-0.2 2,-0.2 -2,-0.2 0.856 116.0 52.0 -68.2 -37.3 36.4 16.7 -2.6 140 140 A N H < S+ 0 0 112 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.886 114.6 40.5 -68.5 -36.1 37.4 20.2 -3.7 141 141 A Q H < S+ 0 0 103 -4,-3.2 -2,-0.2 1,-0.2 -1,-0.2 0.893 133.0 19.9 -80.4 -41.8 38.4 21.4 -0.2 142 142 A T S X S+ 0 0 20 -4,-2.2 4,-2.6 -5,-0.3 -1,-0.2 -0.509 73.0 161.5-126.0 63.3 40.2 18.2 1.0 143 143 A P H > + 0 0 47 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.795 69.9 51.5 -55.6 -39.1 41.0 16.4 -2.2 144 144 A N H > S+ 0 0 112 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.946 116.3 40.2 -68.0 -44.3 43.8 14.0 -0.8 145 145 A R H > S+ 0 0 22 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.946 115.3 52.4 -65.9 -48.3 41.6 12.7 2.0 146 146 A A H X S+ 0 0 0 -4,-2.6 4,-2.9 -8,-0.2 5,-0.2 0.924 108.6 51.4 -51.7 -48.7 38.5 12.6 -0.3 147 147 A K H X S+ 0 0 95 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.870 108.3 52.1 -58.9 -38.9 40.5 10.5 -2.9 148 148 A R H X S+ 0 0 66 -4,-1.6 4,-1.5 -5,-0.2 -1,-0.2 0.953 112.8 43.3 -62.2 -46.3 41.4 8.1 -0.2 149 149 A V H X S+ 0 0 0 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.926 113.8 51.8 -64.5 -42.5 37.8 7.6 0.9 150 150 A I H X S+ 0 0 14 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.844 106.6 52.4 -62.2 -40.0 36.6 7.4 -2.6 151 151 A T H X S+ 0 0 36 -4,-2.2 4,-2.2 2,-0.2 6,-0.3 0.836 106.2 56.4 -66.2 -35.4 39.2 4.7 -3.5 152 152 A T H X S+ 0 0 0 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.901 110.8 41.9 -64.1 -45.6 38.0 2.7 -0.5 153 153 A F H < S+ 0 0 2 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.885 115.4 51.9 -69.3 -38.0 34.4 2.8 -1.8 154 154 A R H < S+ 0 0 106 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.926 124.9 20.9 -62.4 -43.5 35.5 2.1 -5.4 155 155 A T H < S- 0 0 44 -4,-2.2 -2,-0.2 2,-0.2 -3,-0.2 0.637 84.4-133.4-104.2 -27.7 37.7 -1.0 -4.6 156 156 A G S < S+ 0 0 17 -4,-2.1 2,-0.2 -5,-0.3 -62,-0.2 0.599 73.3 100.4 80.1 8.0 36.7 -2.4 -1.4 157 157 A T S S- 0 0 46 -6,-0.3 3,-0.3 -5,-0.1 -1,-0.3 -0.706 79.5-119.7-119.7 172.9 40.3 -2.7 -0.2 158 158 A W S > S+ 0 0 42 -2,-0.2 3,-2.6 1,-0.2 4,-0.4 0.171 72.1 124.4 -95.4 14.3 42.6 -0.6 2.2 159 159 A D G > + 0 0 92 1,-0.3 3,-1.6 2,-0.2 -1,-0.2 0.830 63.7 56.3 -44.6 -46.5 44.9 0.0 -0.7 160 160 A A G 3 S+ 0 0 35 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.616 110.7 46.7 -65.3 -13.2 44.8 3.9 -0.4 161 161 A Y G < 0 0 19 -3,-2.6 -1,-0.3 -13,-0.1 -2,-0.2 0.312 360.0 360.0-110.1 2.1 45.9 3.7 3.2 162 162 A K < 0 0 175 -3,-1.6 -2,-0.2 -4,-0.4 -3,-0.1 0.660 360.0 360.0-112.3 360.0 48.7 1.2 2.7